6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-1-carboxylic acid

Systemtic Name: 6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-1-carboxylic acid Openeye Name: 6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-1-carboxylic acid CAS Name: 6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-1-carboxylic acid IUPAC Name: 6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-1-carboxylic acid Traditional Name: 6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-1-carboxylic acid Formula: C17H11FN4O2 MolecularWeight: 322.293243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=NN=C(N2C3=CC=CC=C3C(=N1)C4=CC=CC=C4F)C(=O)O

Isomeric SMILES

C1C2=NN=C(N2C3=CC=CC=C3C(=N1)C4=CC=CC=C4F)C(=O)O

InChI

InChI=1S/C17H11FN4O2/c18-12-7-3-1-5-10(12)15-11-6-2-4-8-13(11)22-14(9-19-15)20-21-16(22)17(23)24/h1-8H,9H2,(H,23,24)